CN(C)c1nc(N(C)C)c2ncc(=O)[nH]c2n1    mol8112    0_1
CN(C)c1nc([NH+](C)C)c2ncc(=O)[nH]c2n1    mol8112    1_1
CN(C)c1nc([NH+](C)C)nc2[nH]c(=O)cnc12    mol8112    1_2
CN(C)c1nc2[nH]c(=O)cnc2c(N(C)C)[nH+]1    mol8112    1_3
CN(C)c1nc(N(C)C)c2[nH+]cc(=O)[nH]c2n1    mol8112    1_4
CN(C)c1nc(N(C)C)c2ncc(=O)[nH]c2[nH+]1    mol8112    1_5
CN(C)c1nc(N(C)C)c2ncc(=O)[n-]c2n1    mol8112    -1_1